3-methyl-2-[(5Z)-4-oxidanylidene-5-(1H-pyrrol-2-ylmethylidene)-2-sulfanylidene-1,3-thiazolidin-3-yl]pentanoic acid

Systemtic Name: 3-methyl-2-[(5Z)-4-oxidanylidene-5-(1H-pyrrol-2-ylmethylidene)-2-sulfanylidene-1,3-thiazolidin-3-yl]pentanoic acid Openeye Name: 3-methyl-2-[(5Z)-4-oxo-5-(1H-pyrrol-2-ylmethylene)-2-thioxo-thiazolidin-3-yl]pentanoic acid CAS Name: 3-methyl-2-[(5Z)-4-oxo-5-(1H-pyrrol-2-ylmethylidene)-2-sulfanylidene-3-thiazolidinyl]pentanoic acid IUPAC Name: 3-methyl-2-[(5Z)-4-oxo-5-(1H-pyrrol-2-ylmethylidene)-2-sulfanylidene-1,3-thiazolidin-3-yl]pentanoic acid Traditional Name: 2-[(5Z)-4-keto-5-(1H-pyrrol-2-ylmethylene)-2-thioxo-thiazolidin-3-yl]-3-methyl-valeric acid Formula: C14H16N2O3S2 MolecularWeight: 324.41844

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)O)N1C(=O)C(=CC2=CC=CN2)SC1=S

Isomeric SMILES

CCC(C)C(C(=O)O)N1C(=O)/C(=C/C2=CC=CN2)/SC1=S

InChI

InChI=1S/C14H16N2O3S2/c1-3-8(2)11(13(18)19)16-12(17)10(21-14(16)20)7-9-5-4-6-15-9/h4-8,11,15H,3H2,1-2H3,(H,18,19)/b10-7-